| SpectraBase Compound ID | BjTS5zQOkC2 |
|---|---|
| InChI | InChI=1S/C25H49NO4/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-30-24(27)23(3)26(4)25(28)29-6-2/h23H,5-22H2,1-4H3 |
| InChIKey | RKWXWRHADQHLOJ-UHFFFAOYSA-N |
| Mol Weight | 427.7 g/mol |
| Molecular Formula | C25H49NO4 |
| Exact Mass | 427.366159 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 99JXXPwaO0b |
|---|---|
| Name | Alanine, N-methyl-N-ethoxycarbonyl-, octadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 427.366159058 u |
| Formula | C25H49NO4 |
| InChI | InChI=1S/C25H49NO4/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-30-24(27)23(3)26(4)25(28)29-6-2/h23H,5-22H2,1-4H3 |
| InChIKey | RKWXWRHADQHLOJ-UHFFFAOYSA-N |
| Molecular Weight | 427.670 g/mol |
| SMILES | CCOC(N(C(C(OCCCCCCCCCCCCCCCCCC)=O)C)C)=O |